Conformational behaviour of 2,2?-bipyrrole

Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules

R. Ditchfield, Warren J. Hehre, John A. Pople · The Journal of Chemical Physics · 1971 · 10.4K citations

Extended Basis Set, Engineering, Theoretical Inorganic Chemistry +23

Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic Orbitals

Warren J. Hehre, R. F. Stewart, John A. Pople · The Journal of Chemical Physics · 1969 · 4.2K citations

Engineering, Self-consistent Molecular-orbital Methods, Computational Chemistry +18

Chain-length dependence of electronic and electrochemical properties of conjugated systems: polyacetylene, polyphenylene, polythiophene, and polypyrrole

Jean‐Luc Brédas, R. Silbey, D. S. Boudreaux et al. · Journal of the American Chemical Society · 1983 · 1.2K citations

Engineering, Altmetric Attention Score, Organic Chemistry +18

Electrochemical polymerization of pyrrole

A. F. Díaz, K. Keiji Kanazawa, G. P. Gardini · Journal of the Chemical Society Chemical Communications · 1979 · 1.1K citations

Materials Science, Conducting Polymer, Chemical Engineering +14

Highly conducting polyparaphenylene, polypyrrole, and polythiophene chains: An<i>ab initio</i>study of the geometry and electronic-structure modifications upon doping

Jean‐Luc Brédas, B. Thémans, J. G. Fripiat et al. · Physical review. B, Condensed matter · 1984 · 722 citations

Engineering, Organic Electronics, Bipolaron Bands +18